AC1NKBBE
N-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-phenylacetamide
Also Known As: (Z)-N-(3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)-2-phenylacetamide|N-[(2E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-2-phenylacetamide|N-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-phenylacetamide
| Molecular Formula | C21H20N2O5S2 |
|---|---|
| Molecular Weight | 444.08136 g/mol |
| LogP | 2.3019 |
| Topological Polar Surface Area | 85.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 444.08136 |
| Monoisotopic Mass | 444.08136 |
| Heavy Atoms | 30 |
| Complexity | 1117.4716 |
Chemical Identifiers
| CAS Number | 902017-95-2 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)N3C4CS(=O)(=O)CC4SC3=NC(=O)CC5=CC=CC=C5 |
Product Overview
AC1NKBBE (CAS 902017-95-2), with molecular formula C21H20N2O5S2 and molecular weight 444.08136 g/mol. IUPAC: N-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-phenylacetamide.
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